REMARK  Name = BDB024483
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.502   1.232   0.339  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1        3.662   0.247  -0.210  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1        4.072  -0.474  -1.442  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1        5.251  -1.425  -1.167  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1        2.964  -1.305  -2.109  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1        1.639  -0.582  -2.043  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1        1.312  -0.376  -0.594  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        0.003  -0.545  -0.097  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1       -1.136  -0.922  -0.766  0.00  0.00    -0.231 NA
ATOM     10  C   LIG    1       -2.108  -0.929   0.128  0.00  0.00    +0.118 A 
ATOM     11  N   LIG    1       -1.616  -0.577   1.370  0.00  0.00    -0.330 N 
ATOM     12  C   LIG    1       -2.378  -0.462   2.590  0.00  0.00    +0.150 C 
ATOM     13  C   LIG    1       -0.271  -0.317   1.244  0.00  0.00    +0.069 A 
ATOM     14  C   LIG    1        0.712   0.091   2.147  0.00  0.00    +0.030 A 
ATOM     15  C   LIG    1        2.008   0.266   1.643  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1        2.329   0.046   0.294  0.00  0.00    +0.045 A 
ATOM     17  O   LIG    1        4.265   1.925   1.323  0.00  0.00    -0.226 OA
ENDROOT
BRANCH   1  19
ATOM     18  C   LIG    1        6.531   2.405   0.115  0.00  0.00    +0.282 C 
ATOM     19  O   LIG    1        5.653   1.394  -0.383  0.00  0.00    -0.453 OA
ENDBRANCH   1  19
BRANCH  10  20
ATOM     20  C   LIG    1       -3.558  -1.259  -0.148  0.00  0.00    +0.082 C 
ATOM     21  C   LIG    1       -3.743  -1.860  -1.547  0.00  0.00    +0.020 C 
BRANCH  20  22
ATOM     22  C   LIG    1       -4.484  -0.063   0.030  0.00  0.00    -0.037 A 
ATOM     23  C   LIG    1       -5.655  -0.188   0.794  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -6.513   0.901   0.964  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -6.214   2.125   0.369  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -5.061   2.261  -0.401  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -4.203   1.174  -0.574  0.00  0.00    +0.004 A 
ENDBRANCH  20  22
ENDBRANCH  10  20
TORSDOF 3